N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide

C15H14F2N2O3S — CID 75391228

IUPACN-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide
SMILESCC(CC(=O)NS(=O)(=O)c1ccc(F)cc1F)c1ccncc1
InChIInChI=1S/C15H14F2N2O3S/c1-10(11-4-6-18-7-5-11)8-15(20)19-23(21,22)14-3-2-12(16)9-13(14)17/h2-7,9-10H,8H2,1H3,(H,19,20)
InChIKeyUGHQJTOMTVWJFX-UHFFFAOYSA-N
MW340.35 g/mol
LogP2.36
Rot. Bonds5

About N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide

N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide (PubChem CID 75391228) has the molecular formula C15H14F2N2O3S and a molecular weight of 340.35 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide
PubChem CID75391228
Molecular FormulaC15H14F2N2O3S
Molecular Weight340.35 g/mol
Exact Mass340.07
IUPAC NameN-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide
SMILESCC(CC(=O)NS(=O)(=O)c1ccc(F)cc1F)c1ccncc1
InChIInChI=1S/C15H14F2N2O3S/c1-10(11-4-6-18-7-5-11)8-15(20)19-23(21,22)14-3-2-12(16)9-13(14)17/h2-7,9-10H,8H2,1H3,(H,19,20)
InChIKeyUGHQJTOMTVWJFX-UHFFFAOYSA-N
XLogP2.36
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide?
The IUPAC name of N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide (CID 75391228) is N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide.
What is the SMILES notation for N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide?
The canonical SMILES for N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide is CC(CC(=O)NS(=O)(=O)c1ccc(F)cc1F)c1ccncc1.
What is the InChIKey of N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide?
The InChIKey is UGHQJTOMTVWJFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O3S/c1-10(11-4-6-18-7-5-11)8-15(20)19-23(21,22)14-3-2-12(16)9-13(14)17/h2-7,9-10H,8H2,1H3,(H,19,20).
What are the key properties of N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide?
N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide has a molecular weight of 340.35 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)sulfonyl-3-pyridin-4-ylbutanamide is sourced from PubChem (CID 75391228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).